In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | No |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.12 | 7.6 | -39.2 | 2 | 3 | 1 | 37 | 273.466 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 6.28 | -5.5 | 1 | 3 | 0 | 32 | 272.458 | 7 | ↓ |